N-[(4-pentoxyphenyl)carbamothioyl]-1-benzofuran-2-carboxamide

Systemtic Name: N-[(4-pentoxyphenyl)carbamothioyl]-1-benzofuran-2-carboxamide Openeye Name: N-[(4-pentoxyphenyl)carbamothioyl]benzofuran-2-carboxamide CAS Name: N-[(4-pentoxyanilino)-sulfanylidenemethyl]-2-benzofurancarboxamide IUPAC Name: N-[(4-pentoxyphenyl)carbamothioyl]-1-benzofuran-2-carboxamide Traditional Name: N-[(4-amoxyphenyl)thiocarbamoyl]coumarilamide Formula: C21H22N2O3S MolecularWeight: 382.47598

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCOC1=CC=C(C=C1)NC(=S)NC(=O)C2=CC3=CC=CC=C3O2

Isomeric SMILES

CCCCCOC1=CC=C(C=C1)NC(=S)NC(=O)C2=CC3=CC=CC=C3O2

InChI

InChI=1S/C21H22N2O3S/c1-2-3-6-13-25-17-11-9-16(10-12-17)22-21(27)23-20(24)19-14-15-7-4-5-8-18(15)26-19/h4-5,7-12,14H,2-3,6,13H2,1H3,(H2,22,23,24,27)